Ethylenediaminetetra(methylenephosphonic acid) (HCID 15025)

개요

Lexidronam is a phosphonate analog of ethylenediaminetetraacetic acid (EDTA), with chelating activity. Lexidronam binds to and associates with hydroxyapatite crystals concentrated in areas of bone turnover. It has been used as a radiopharmaceutical in complexes with radioactive metals to selectively deliver cytotoxic radiation to osteoblastic bone metastases.

이름 및 식별자

우선 이름: Ethylenediaminetetra(methylenephosphonic acid)
IUPAC: [2-[bis(phosphonomethyl)amino]ethyl-(phosphonomethyl)amino]methylphosphonic acid
현지명: N,N,N',N'-에틸렌디아민테트라(메틸렌인 산)
영어명: Ethylenebis(nitrilodimethylene)tetraphosphonic acid
분자식: C6H20N2O12P4
분자량: 436.12

이름 및 동의어

1429-50-1LexidronamEthylenediaminetetra(methylenephosphonic acid)V4CP8RSX7VBRIQUEST 422-25SDTXSID3061689EDTPO(Ethylenedinitrilo)-tetramethylenephosphonic acidEthylenediamine tetra(methylene phosphonic acid)PH540Ethylenediamine tetrakis(methylene phosphonic acid)PH-540

이름 더 보기

N,N,N',N'-에틸렌디아민테트라(메틸렌인산)N,N,N',N'-에틸렌디아민테트라(메틸렌인산)(N,N,N',N'-ETHYLENEDIAMINETETRA(M...edtmpMethylene Phosphonic AcidETHYLENEDIAMINE TETRA(METHYLENEPHOSPHONIC ACID)EDTMPS·Na8sandeqingxiDequest 2041EDTMP, EDTMPAtetrakis(methylene)

Phosphonic acid, (1,2-ethanediylbis(nitrilobis(methylene)))tetrakis-editempaeditempa acid68Ga-EDTMPRefChem:406469DTXCID9034654ethylenediaminetetra(methylenephosphonic)acidN,N,N',N' ethylenediamine tetra(methylenephosphonic acid)

데이터베이스 식별자

CAS: 1429-50-1、15142-96-8、22036-77-7、61827-49-4
PubChem CID: 15025
DTXSID: DTXSID3061689
ChEMBL: CHEMBL1208647
UNII: V4CP8RSX7V
EC Number: 215-851-5、263-254-3
Nikkaji: J56.130D

물성

구조 계산 물성

XLogP: -11.2
극성 표면적: 237 Å²
수소 결합 공여자 수: 8
수소 결합 수용자 수: 14
회전 가능 결합 수: 11
무거운 원자 수: 24
형식 전하: 0
복잡도: 486

실험 및 물리화학적 성질

Chemical ClassesOther Classes -> Phosphate Compounds

DrugsPharmaceuticals -> Listed in ZINC15

CosmeticsChelating

Physical DescriptionSolid; [Sigma-Aldrich MSDS]

물리화학적 성질

녹는점: 247 °C · 247 °C
끓는 점: 878.7 · 878.7±75.0 °C(Predicted)
밀도: 1.993 · 1.993±0.06 g/cm3(Predicted)
증기압: 0 Pa · 0Pa at 25℃
저장 조건: -20 °C · Hygroscopic, -20°C Freezer, Under inert atmosphere
용해도: 알칼리성 용액에 용해됨(약간 용해됨)
물리적 상태: 고체
산도 계수 (pKa): 0.13 · 0.13±0.10(Predicted)
색상: 하얀색
수용성: 19.6 g/L · 19.6g/L at 20℃
InChI: InChI=1S/C6H20N2O12P4/c9-21(10,11)3-7(4-22(12,13)14)1-2-8(5-23(15,16)17)6-24(18,19)20/h1-6H2,(H2,9,10,11)(H2,12,13,14)(H2,15,16,17)(H2,18,19,20)
InChIKey: NFDRPXJGHKJRLJ-UHFFFAOYSA-N
SMILES: P(=O)(O)(O)CN(CCN(CP(=O)(O)O)CP(=O)(O)O)CP(=O)(O)O
LogP: -4.1 · -4.1
EPA: Ethylenediamine tetrakis(methylene phosphonic acid) (1429-50-1)

안전 및 규제

GHS 분류

GHS Classification · 6건

Warning

H315 (58.7%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 327 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Danger

H335: May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

유해성 정보

Regulatory Information · 3건

Chemical: Phosphonic acid, [1,2-ethanediylbis[nitrilobis(methylene)]]tetrakis-

Status: Active Update: 24-10-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/23979

Phosphonic acid, [1,2-ethanediylbis[nitrilobis(methylene)]]tetrakis-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazards Summary · 1건

Not sensitizing in guinea pigs; No evidence of mutagenicity; Similar phosphonate compounds demonstrate moderate skin and eye irritation and no evidence of teratogenicity; [Reference #1] A skin and strong eye irritant; [Sigma-Aldrich MSDS] See Aminotrimethylene phosphonic acid.

Hazard Classes and Categories · 2건

Skin Irrit. 2 (58.7%)

Carcinogenicity - Category 1B

안전 데이터

tsca: TSCA listed
HS 번호: 29212900
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36/37/39
기존화학 물질: KE-13197

화학 및 산업

약리 정보

MeSH Pharmacological ClassificationChemicals that bind to and remove ions from solutions. Many chelating agents function through the formation of COORDINATION COMPLEXES with METALS.

용도 및 제조

UsesUsed in consumer dishwashing and laundry detergents; [Reference #1]

Use ClassificationCosmetics -> Chelating

General Manufacturing InformationPhosphonic acid, P,P',P'',P'''-[1,2-ethanediylbis[nitrilobis(methylene)]]tetrakis-: ACTIVE

응용 분야

용도Ethylenediaminetetra(methylenephosphonic acid) is a nitrogenous polyphosphonic acid chelator is able to form complexes with various metal ions.

상·하류 제품 정보

상류 원료

하류 제품

boiler water treatment agent NS-404 boiler watet treatment agent NS-401

공급사50 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]

河北创海生物科技有限公司+86-86-13131129325 · [email protected]

Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

연결된 노트

불러오는 중…

N,N,N',N'-에틸렌디아민테트라(메틸렌인 산)

기본 정보

개요